(20S,23)-dihydroxyvitamin D3 (Q27163200)

20S,23-dihydroxyvitamin D3 (English)

9 October 2016

chemical formula

C₂₇H₄₄O₃

1 reference

20S,23-dihydroxyvitamin D3 (English)

9 October 2016

canonical SMILES

CC(C)CC(CC(C)(C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)C)O)O

1 reference

20S,23-dihydroxyvitamin D3 (English)

9 October 2016

isomeric SMILES

CC(C)CC(C[C@@](C)([C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](CCC3=C)O)C)O)O

1 reference

20S,23-dihydroxyvitamin D3 (English)

InChI=1S/C27H44O3/c1-18(2)15-23(29)17-27(5,30)25-13-12-24-20(7-6-14-26(24,25)4)9-10-21-16-22(28)11-8-19(21)3/h9-10,18,22-25,28-30H,3,6-8,11-17H2,1-2,4-5H3/b20-9+,21-10-/t22-,23?,24-,25-,26-,27-/m0/s1

9 October 2016

Identifiers

InChI

1 reference

20S,23-dihydroxyvitamin D3 (English)

PFGAVEWICNHWDW-OZCLJXQISA-N

9 October 2016

InChIKey

2 references

20S,23-dihydroxyvitamin D3 (English)

9 October 2016

stated in

ChEBI release 2020-09-01

2 references

20S,23-dihydroxyvitamin D3 (English)

matched by identifier from

9 October 2016

InChIKey

PFGAVEWICNHWDW-OZCLJXQISA-N

Reaxys registry number

20673696

1 reference

(20S,23)-dihydroxyvitamin D3 (English)

9 October 2016

ChEBI ID

91306

mapping relation type

2 references

(20S,23)-dihydroxyvitamin D3 (English)